3-(5-ethoxycarbonylpyridin-3-yl)prop-2-ynyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Systemtic Name: 3-(5-ethoxycarbonylpyridin-3-yl)prop-2-ynyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: 3-(5-ethoxycarbonyl-3-pyridyl)prop-2-ynyl 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid 3-(5-ethoxycarbonyl-3-pyridinyl)prop-2-ynyl ester IUPAC Name: 3-(5-ethoxycarbonylpyridin-3-yl)prop-2-ynyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid 3-(5-carbethoxy-3-pyridyl)prop-2-ynyl ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CC(=C1)C#CCOC(=O)C2=C(ON=C2C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CN=CC(=C1)C#CCOC(=O)C2=C(ON=C2C3=CC=CC=C3)C

InChI

InChI=1S/C22H18N2O5/c1-3-27-21(25)18-12-16(13-23-14-18)8-7-11-28-22(26)19-15(2)29-24-20(19)17-9-5-4-6-10-17/h4-6,9-10,12-14H,3,11H2,1-2H3